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About This Item
Linear Formula:
C6H513CH2Br
CAS Number:
Molecular Weight:
172.03
NACRES:
NA.12
PubChem Substance ID:
UNSPSC Code:
12352101
MDL number:
Isotopic purity:
99 atom % 13C
Assay:
99% (CP)
Mass shift:
M+1
isotopic purity
99 atom % 13C
Quality Segment
assay
99% (CP)
refractive index
n
bp
198-199 °C (lit.)
mp
−3-−1 °C (lit.)
density
1.446 g/mL at 25 °C
mass shift
M+1
SMILES string
Br[13CH2]c1ccccc1
InChI
1S/C7H7Br/c8-6-7-4-2-1-3-5-7/h1-5H,6H2/i6+1
InChI key
AGEZXYOZHKGVCM-PTQBSOBMSA-N
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials
wgk
WGK 2
flash_point_f
186.8 °F - closed cup
flash_point_c
86 °C - closed cup
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